COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK530133
Chemical Name: methyl(5Z)-5-{1-[(4-aminophenyl)amino]butylidene}-2,2-dimethyl-4,6-dioxocyclohexanecarboxylate
Smiles: CCC/C(=C/1\C(=O)CC(C(C1=O)C(=O)OC)(C)C)/Nc1ccc(cc1)N

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Molecular Weight: 358.44
Empirical Formula: C20H26N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.838
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 98
Number of rings: 2

     

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